| SpectraBase Spectrum ID |
IhOvyqlQ4Wy |
| Name |
1H-Inden-1-one, octahydro-5-(2-hydroxy-4-methoxyphenyl)-4-(hydroxymethyl)-7a-methyl-, [3aR-(3a.alpha.,4.alpha.,5.alpha.,7a.alpha.)]- |
| Alternate Name(s) |
(3aR,4S,5S,7aS)-5-(2-hydroxy-4-methoxyphenyl)-4-(hydroxymethyl)-7a-methyloctahydro-1H-inden-1-one
14.beta.-3-methoxy-5,7-dihydroxy-5,6-seco-6-oxaestra-1,3,5(10)-trien-17-one |
| CAS Registry Number |
75671-31-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O4 |
| InChI |
InChI=1S/C18H24O4/c1-18-8-7-12(13-4-3-11(22-2)9-16(13)20)14(10-19)15(18)5-6-17(18)21/h3-4,9,12,14-15,19-20H,5-8,10H2,1-2H3/t12-,14+,15-,18+/m1/s1 |
| InChIKey |
SEWJCKMZGKHISF-PXMRGAAZSA-N |
| Molecular Weight |
304.386 g/mol |
| SMILES |
OC[C@@]1([C@@]2([C@](CC[C@@]1(c1c(cc(cc1)OC)O)[H])(C(CC2)=O)C)[H])[H] |
| SPLASH |
splash10-0w29-0906000000-4370a38315e8cebbd9d7 |
| Source of Spectrum |
I-58-1433-0 |
| Wiley ID |
1306564 |
![1H-Inden-1-one, octahydro-5-(2-hydroxy-4-methoxyphenyl)-4-(hydroxymethyl)-7a-methyl-, [3aR-(3a.alpha.,4.alpha.,5.alpha.,7a.alpha.)]-](/api/spectrum/IhOvyqlQ4Wy/structure.png?h=300&w=458 "1H-Inden-1-one, octahydro-5-(2-hydroxy-4-methoxyphenyl)-4-(hydroxymethyl)-7a-methyl-, [3aR-(3a.alpha.,4.alpha.,5.alpha.,7a.alpha.)]-")
